SCHEMBL20068439

SCHEMBL20068439

Brc1ccc2c(c1)c1ccccc1n2-c1nc(-c2ccccc2)c2c(n1)sc1ccccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.35
▸ PPARG P37231 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ NCOR2 Q9Y618 1/20 0.35
▸ DCLK1 O15075 1/20 0.34
▸ PRKD3 O94806 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ CHEK2 O96017 1/20 0.34
▸ CSF1R P07333 1/20 0.34
▸ FER P16591 1/20 0.34
▸ CDK2 P24941 1/20 0.34
▸ MARK3 P27448 1/20 0.34
▸ FLT4 P35916 1/20 0.34
▸ FLT3 P36888 1/20 0.34
▸ MAPK9 P45984 1/20 0.34
▸ CSNK1D P48730 1/20 0.34
▸ CLK2 P49760 1/20 0.34
▸ CSNK2A1 P68400 1/20 0.34
▸ CSNK1G2 P78368 1/20 0.34
▸ MAP4K2 Q12851 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16905742 0.90 KDM4E (0.35) ATMKMT2ANPSR1GAANPC1
SCHEMBL20068433 0.86 CYP1A1 (0.36) ATMPPARGRXFP1NCOR2DCLK1
SCHEMBL18674879 0.86 KDM4E (0.38) ATMKMT2ANPY5RTSPOL3MBTL1
SCHEMBL19246503 0.86 L3MBTL1 (0.40) ATMRXFP1MEN1KMT2ANPSR1
SCHEMBL19246417 0.85 L3MBTL1 (0.39) ATMRXFP1MEN1KMT2AMGAM
SCHEMBL20670041 0.85 NPY5R (0.33) NPY5R
SCHEMBL18961984 0.85 GPR3 (0.30) RAB9A
SCHEMBL18962047 0.85 GPR3 (0.30) RAB9A
SCHEMBL16905628 0.83 KDM4E (0.40) ATMNPY5RL3MBTL1
SCHEMBL18961939 0.83 NPY5R (0.30) NPY5R

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018070824-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2018-04-19 — — WO disclosed
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